methyl 4-chloranyl-3-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-chloro-3-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C14H14ClN3O3S MolecularWeight: 339.79726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl

InChI

InChI=1S/C14H14ClN3O3S/c1-18-6-5-16-14(18)22-8-12(19)17-11-7-9(13(20)21-2)3-4-10(11)15/h3-7H,8H2,1-2H3,(H,17,19)